2-(2H-1,3-benzodioxol-5-yl)-6-methyl-N-[(pyridin-3-yl)methyl]quinoline-4-carboxamide
Chemical Structure Depiction of
2-(2H-1,3-benzodioxol-5-yl)-6-methyl-N-[(pyridin-3-yl)methyl]quinoline-4-carboxamide
2-(2H-1,3-benzodioxol-5-yl)-6-methyl-N-[(pyridin-3-yl)methyl]quinoline-4-carboxamide
Compound characteristics
| Compound ID: | Y200-0943 |
| Compound Name: | 2-(2H-1,3-benzodioxol-5-yl)-6-methyl-N-[(pyridin-3-yl)methyl]quinoline-4-carboxamide |
| Molecular Weight: | 397.43 |
| Molecular Formula: | C24 H19 N3 O3 |
| Smiles: | Cc1ccc2c(c1)c(cc(c1ccc3c(c1)OCO3)n2)C(NCc1cccnc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.692 |
| logD: | 4.6824 |
| logSw: | -4.1978 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.344 |
| InChI Key: | WXIRRARTRLJOHN-UHFFFAOYSA-N |